ethyl 3-[4-[4-(1-benzofuran-5-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate

Systemtic Name: ethyl 3-[4-[4-(1-benzofuran-5-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: ethyl 3-[4-[4-(benzofuran-5-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[4-(5-benzofuranyl)-1-piperazinyl]butyl]-1H-indole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-[4-(1-benzofuran-5-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-[4-(benzofuran-5-yl)piperazino]butyl]-1H-indole-5-carboxylic acid ethyl ester Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCN(CC3)C4=CC5=C(C=C4)OC=C5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCN(CC3)C4=CC5=C(C=C4)OC=C5

InChI

InChI=1S/C27H31N3O3/c1-2-32-27(31)21-6-8-25-24(18-21)22(19-28-25)5-3-4-11-29-12-14-30(15-13-29)23-7-9-26-20(17-23)10-16-33-26/h6-10,16-19,28H,2-5,11-15H2,1H3